SCHEMBL10175804

SCHEMBL10175804

CCOc1ccc(S(=O)(=O)N2CCC(n3cc(C)c4ccc(Cl)cc43)C2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 15/20 1.00
PKM P14618 2/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HCRTR1 O43613 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10175793 0.94 PTGDR2 (1.00) PTGDR2PKMKMT2ATDP1GAA
SCHEMBL10175787 0.93 PTGDR2 (1.00) PTGDR2PKMKMT2AMEN1TDP1
SCHEMBL10226373 0.87 PTGDR2 (1.00) PTGDR2
SCHEMBL10175795 0.87 PTGDR2 (1.00) PTGDR2
SCHEMBL10175779 0.87 PTGDR2 (1.00) PTGDR2PKMKMT2ATDP1GAA
SCHEMBL840640 0.86 PTGDR2 (0.81) PTGDR2PKMKMT2AGAA
SCHEMBL10175789 0.81 PTGDR2 (1.00) PTGDR2
SCHEMBL840180 0.81 PTGDR2 (0.75) PTGDR2PKMKMT2A
SCHEMBL10175767 0.81 PTGDR2 (0.75) PTGDR2PKMKMT2AGAANPSR1
SCHEMBL840501 0.80 PTGDR2 (0.75) PTGDR2PKMKMT2AGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8623903-B2 Indolecarboxylic acid derivative having PGD2 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2014-01-07 US disclosed
US-20120142687-A1 INDOLECARBOXYLIC ACID DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONISTIC ACTIVITY KUGIMIYA AKIRA (JP) 2012-06-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120142687-A1 INDOLECARBOXYLIC ACID DERIVATIVE HAVING PGD2 RECEPTOR ANTAGONISTIC ACTIVITY PTGDR, CYSLTR1, CYSLTR2 PTGDR2 7/4885PKM 4008/4885KMT2A 3174/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.